2-butyl-3-[4-[(E)-3-(dibutylamino)prop-1-enyl]phenyl]carbonyl-1-benzofuran-5-carboxamide; ethanedioic acid

Systemtic Name: 2-butyl-3-[4-[(E)-3-(dibutylamino)prop-1-enyl]phenyl]carbonyl-1-benzofuran-5-carboxamide; ethanedioic acid Openeye Name: 2-butyl-3-[4-[(E)-3-(dibutylamino)prop-1-enyl]benzoyl]benzofuran-5-carboxamide; oxalic acid CAS Name: 2-butyl-3-[[4-[(E)-3-(dibutylamino)prop-1-enyl]phenyl]-oxomethyl]-5-benzofurancarboxamide; oxalic acid IUPAC Name: 2-butyl-3-[4-[(E)-3-(dibutylamino)prop-1-enyl]benzoyl]-1-benzofuran-5-carboxamide; oxalic acid Traditional Name: 2-butyl-3-[4-[(E)-3-(dibutylamino)prop-1-enyl]benzoyl]benzofuran-5-carboxamide; oxalic acid Formula: C33H42N2O7 MolecularWeight: 578.69578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)N)C(=O)C3=CC=C(C=C3)C=CCN(CCCC)CCCC.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)N)C(=O)C3=CC=C(C=C3)/C=C/CN(CCCC)CCCC.C(=O)(C(=O)O)O

InChI

InChI=1S/C31H40N2O3.C2H2O4/c1-4-7-12-28-29(26-22-25(31(32)35)17-18-27(26)36-28)30(34)24-15-13-23(14-16-24)11-10-21-33(19-8-5-2)20-9-6-3;3-1(4)2(5)6/h10-11,13-18,22H,4-9,12,19-21H2,1-3H3,(H2,32,35);(H,3,4)(H,5,6)/b11-10+;